2,6-dimethyl-4-(1-pyridin-4-ylethylamino)pyridine-3-carbonitrile

C15H16N4 — CID 81060922

IUPAC2,6-dimethyl-4-(1-pyridin-4-ylethylamino)pyridine-3-carbonitrile
SMILESCc1cc(NC(C)c2ccncc2)c(C#N)c(C)n1
InChIInChI=1S/C15H16N4/c1-10-8-15(14(9-16)12(3)18-10)19-11(2)13-4-6-17-7-5-13/h4-8,11H,1-3H3,(H,18,19)
InChIKeyZWTYEEQIFUMEPE-UHFFFAOYSA-N
MW252.32 g/mol
LogP3.14
Rot. Bonds3

About 2,6-dimethyl-4-(1-pyridin-4-ylethylamino)pyridine-3-carbonitrile

2,6-dimethyl-4-(1-pyridin-4-ylethylamino)pyridine-3-carbonitrile (PubChem CID 81060922) has the molecular formula C15H16N4 and a molecular weight of 252.32 g/mol. Its IUPAC name is 2,6-dimethyl-4-(1-pyridin-4-ylethylamino)pyridine-3-carbonitrile.

Molecular Properties

Compound Name2,6-dimethyl-4-(1-pyridin-4-ylethylamino)pyridine-3-carbonitrile
PubChem CID81060922
Molecular FormulaC15H16N4
Molecular Weight252.32 g/mol
Exact Mass252.14
IUPAC Name2,6-dimethyl-4-(1-pyridin-4-ylethylamino)pyridine-3-carbonitrile
SMILESCc1cc(NC(C)c2ccncc2)c(C#N)c(C)n1
InChIInChI=1S/C15H16N4/c1-10-8-15(14(9-16)12(3)18-10)19-11(2)13-4-6-17-7-5-13/h4-8,11H,1-3H3,(H,18,19)
InChIKeyZWTYEEQIFUMEPE-UHFFFAOYSA-N
XLogP3.14
TPSA61.60 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.32
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(3,3-dimethylbutan-2-ylamino)-2,6-dimethylpyridine-3-carbonitrile
CID 104828350
4-[1-(2,5-dimethylfuran-3-yl)ethylamino]-2,6-dimethylpyridine-3-carbonitrile
CID 81042486
2,6-dimethyl-4-(pentan-2-ylamino)pyridine-3-carbonitrile
CID 81061203
2,6-dimethyl-4-(2-pyridin-4-ylethylamino)pyridine-3-carbonitrile
CID 81060354
2,6-dimethyl-4-[1-(4-methyl-1,2,4-triazol-3-yl)ethylamino]pyridine-3-carbonitrile
CID 81061348
2,6-dimethyl-4-(3-methylbutylamino)pyridine-3-carbonitrile
CID 81042476
4-[1-(diethylamino)propan-2-ylamino]-2,6-dimethylpyridine-3-carbonitrile
CID 81060744
6-methyl-4-N-(1-pyridin-4-ylethyl)pyrimidine-2,4-diamine
CID 112726063
5-amino-2-(1-pyridin-4-ylethylamino)benzonitrile
CID 61297293
4-(1-pyridin-4-ylethylamino)-3-(trifluoromethyl)benzonitrile
CID 43687076
2,4-dimethyl-N-(1-pyridin-4-ylethyl)aniline
CID 43189781
5-[(3-cyano-2,6-dimethyl-4-pyridinyl)amino]hexanoic acid
CID 82847005

Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-4-(1-pyridin-4-ylethylamino)pyridine-3-carbonitrile?
The IUPAC name of 2,6-dimethyl-4-(1-pyridin-4-ylethylamino)pyridine-3-carbonitrile (CID 81060922) is 2,6-dimethyl-4-(1-pyridin-4-ylethylamino)pyridine-3-carbonitrile.
What is the SMILES notation for 2,6-dimethyl-4-(1-pyridin-4-ylethylamino)pyridine-3-carbonitrile?
The canonical SMILES for 2,6-dimethyl-4-(1-pyridin-4-ylethylamino)pyridine-3-carbonitrile is Cc1cc(NC(C)c2ccncc2)c(C#N)c(C)n1.
What is the InChIKey of 2,6-dimethyl-4-(1-pyridin-4-ylethylamino)pyridine-3-carbonitrile?
The InChIKey is ZWTYEEQIFUMEPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4/c1-10-8-15(14(9-16)12(3)18-10)19-11(2)13-4-6-17-7-5-13/h4-8,11H,1-3H3,(H,18,19).
What are the key properties of 2,6-dimethyl-4-(1-pyridin-4-ylethylamino)pyridine-3-carbonitrile?
2,6-dimethyl-4-(1-pyridin-4-ylethylamino)pyridine-3-carbonitrile has a molecular weight of 252.32 g/mol, XLogP of 3.14, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-4-(1-pyridin-4-ylethylamino)pyridine-3-carbonitrile is sourced from PubChem (CID 81060922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).